nixos-unstable · x86_64-linux · 151fa4e8ddfd · generated 2026-10-07T10:25:31Z

python313Packages.torchmd-net 3.0.3 single

Library to train state-of-the-art neural networks potentials (NNPs)

Name
python3.13-torchmd-net-3.0.3
Package set
python313Packages
Homepage
https://github.com/torchmd/torchmd-net
License
MIT
Source
pkgs/development/python-modules/torchmd-net/default.nix:91
Derivation
/nix/store/rwsgcgnmswblzz94pwc5scb8ad34ipfh-python3.13-torchmd-net-3.0.3.drv
Repology
not reported as outdated · look up (as of 2026-10-07T10:23:38Z)

Maintainers 1

HandleNameContactVia
GaetanLepage Gaetan Lepage GitHub · gaetan@glepage.com listed on package

Dependencies 29

PackageAsMaintainersUsed by (transitive)Status
python313 3.13.15 propagatedBuildInputs 13,660 team-only outdated
python313Packages.ase 3.29.0 propagatedBuildInputs
13 unmaintained
python313Packages.h5py 3.16.0 propagatedBuildInputs 402 single
python313Packages.lightning 2.6.6 propagatedBuildInputs 4 single
python313Packages.numpy 2.5.2 propagatedBuildInputs 5,137 single outdated
python313Packages.torch 2.13.0 propagatedBuildInputs 399 maintained outdated
python313Packages.torch-geometric 2.8.0.post1 propagatedBuildInputs 2 single
python313Packages.tqdm 4.68.4 propagatedBuildInputs 815 single outdated
python313Packages.warp-lang 1.15.0 propagatedBuildInputs 4 single outdated
ensureNewerSourcesForZipFilesHook 26.05pre-git nativeBuildInputs
74,596 unmaintained setup hook
python313Packages.pypaBuildHook 26.05pre-git nativeBuildInputs
11,598 unmaintained setup hook
python313Packages.pypaInstallHook 26.05pre-git nativeBuildInputs
11,625 unmaintained setup hook
python313Packages.pytest-xdist 3.8.0 nativeBuildInputs 7,922 single
python313Packages.pytestCheckHook 26.05pre-git nativeBuildInputs
10,182 unmaintained setup hook
python313Packages.pythonCatchConflictsHook 26.05pre-git nativeBuildInputs
11,609 unmaintained setup hook
python313Packages.pythonImportsCheckHook 26.05pre-git nativeBuildInputs
11,642 unmaintained setup hook
python313Packages.pythonMetadataCheckHook 26.05pre-git nativeBuildInputs 11,597 single setup hook
python313Packages.pythonNamespacesHook 26.05pre-git nativeBuildInputs
11,634 unmaintained setup hook
python313Packages.pythonOutputDistHook 26.05pre-git nativeBuildInputs
74,564 unmaintained setup hook
python313Packages.pythonRelaxDepsHook 26.05pre-git nativeBuildInputs
11,601 unmaintained setup hook
python313Packages.pythonRemoveBinBytecodeHook 26.05pre-git nativeBuildInputs
74,584 unmaintained setup hook
python313Packages.pythonRemoveTestsDirHook 26.05pre-git nativeBuildInputs
11,634 unmaintained setup hook
python313Packages.pythonRuntimeDepsCheckHook 26.05pre-git nativeBuildInputs
11,611 unmaintained setup hook
python313Packages.setuptools 83.0.0 nativeBuildInputs 11,500 team-only outdated
python313Packages.setuptools-scm 10.0.5 nativeBuildInputs 10,397 single outdated
python313Packages.wrapPython 26.05pre-git nativeBuildInputs
11,634 unmaintained setup hook
writableTmpDirAsHomeHook 26.05pre-git nativeBuildInputs
66,113 unmaintained setup hook
bashNonInteractive 5.3p15 other input 102,441 maintained outdated
stdenv 26.05pre-git other input
90,330 team-only

Used by 0 directly, 0 transitively

No package depends on this one.